 Home > Encyclopedia > methyl 4-[[(2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-3-methyl-1-(4-nitroanilino)-1-oxobutan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoate

methyl 4-[[(2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-3-methyl-1-(4-nitroanilino)-1-oxobutan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoate

methyl 4-[[(2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-3-methyl-1-(4-nitroanilino)-1-oxobutan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoate structure

CAS No:
70967-90-7
Formula:
C27H38N6O9
Chemical Name:
methyl 4-[[(2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-3-methyl-1-(4-nitroanilino)-1-oxobutan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoate
Synonyms:
N-(Methoxysuccinyl)-Ala-Ala-Pro-Val 4-nitroanilide; MeOSuc-Ala-Ala-Pro-Val-p-NA; N-methoxysuccinyl-Ala-Ala-Pro-Val-p-nitroanilide; MeO-Suc-Ala-Ala-Pro-Val-(p-nitroanilide); N-3-carbomethoxypropanoyl-alanyl-alanyl-prolyl-valine p-nitroanilide; MeOSuc-AAPV-PNA; N-(Methoxysuccinyl)-L-alanyl-L-alanyl-L-prolyl-L-valine 4-nitroanilide;Expand
Categories:
Biochemical Engineering > Polypeptide

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methyl 4-[[(2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-3-methyl-1-(4-nitroanilino)-1-oxobutan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoate Basic Attributes

Molecular Weight：

590.62500

Exact Mass：

590.27002681

Characteristics

PSA：

208.83000

XLogP3：

2.33450

Density：

1.297g/cm3

Boiling Point：

908.4ºC

Flash Point：

503.2ºC

Refractive Index：

1.567

Storage Conditions：

-20ºC

Safety Information

safety instructions：

S22-S24/25

Drug Information

MeSH Entry Terms：

AAPV-NA

Computed Properties

Molecular Weight:590.6
XLogP3:0.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:13
Exact Mass:590.27002681
Monoisotopic Mass:590.27002681
Topological Polar Surface Area:209
Heavy Atom Count:42
Complexity:1020
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of methyl 4-[[(2S)-1-[[(2S)-1-[(2S)-2-[[(2S)-3-methyl-1-(4-nitroanilino)-1-oxobutan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoate

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